# generated using pymatgen data_Zr(Fe2P)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.88698600 _cell_length_b 6.88698600 _cell_length_c 3.63502100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr(Fe2P)2 _chemical_formula_sum 'Zr2 Fe8 P4' _cell_volume 172.41114040 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Zr Zr0 1 0.50000000 0.50000000 0.00000000 1.0 Zr Zr1 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe2 1 0.58654300 0.15814900 0.50000000 1.0 Fe Fe3 1 0.41345700 0.84185100 0.50000000 1.0 Fe Fe4 1 0.08654300 0.34185100 0.00000000 1.0 Fe Fe5 1 0.91345700 0.65814900 0.00000000 1.0 Fe Fe6 1 0.15814900 0.58654300 0.50000000 1.0 Fe Fe7 1 0.84185100 0.41345700 0.50000000 1.0 Fe Fe8 1 0.34185100 0.08654300 0.00000000 1.0 Fe Fe9 1 0.65814900 0.91345700 0.00000000 1.0 P P10 1 0.71700800 0.71700800 0.50000000 1.0 P P11 1 0.28299200 0.28299200 0.50000000 1.0 P P12 1 0.21700800 0.78299200 0.00000000 1.0 P P13 1 0.78299200 0.21700800 0.00000000 1.0